N-[4-[5-(hydroxymethyl)furan-2-yl]-3-methoxy-phenyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[4-[5-(hydroxymethyl)furan-2-yl]-3-methoxy-phenyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[4-[5-(hydroxymethyl)-2-furyl]-3-methoxy-phenyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[4-[5-(hydroxymethyl)-2-furanyl]-3-methoxyphenyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[4-[5-(hydroxymethyl)furan-2-yl]-3-methoxyphenyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[3-methoxy-4-(5-methylol-2-furyl)phenyl]-piperonylamide Formula: C20H17NO6 MolecularWeight: 367.35208

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)NC(=O)C2=CC3=C(C=C2)OCO3)C4=CC=C(O4)CO

Isomeric SMILES

COC1=C(C=CC(=C1)NC(=O)C2=CC3=C(C=C2)OCO3)C4=CC=C(O4)CO

InChI

InChI=1S/C20H17NO6/c1-24-18-9-13(3-5-15(18)16-7-4-14(10-22)27-16)21-20(23)12-2-6-17-19(8-12)26-11-25-17/h2-9,22H,10-11H2,1H3,(H,21,23)